CHEBI:93562 - 2-[[4-(3-methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol

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ChEBI Name 2-[[4-(3-methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
ChEBI ID CHEBI:93562
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H22N6O
Net Charge 0
Average Mass 314.386
Monoisotopic Mass 314.18551
InChI InChI=1S/C16H22N6O/c1-12-5-4-6-13(11-12)18-15-19-14(17-7-10-23)20-16(21-15)22-8-2-3-9-22/h4-6,11,23H,2-3,7-10H2,1H3,(H2,17,18,19,20,21)
InChIKey DSLSXSSYABXXSB-UHFFFAOYSA-N
SMILES CC1=CC(=CC=C1)NC2=NC(=NC(=N2)N3CCCC3)NCCO
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 2-[[4-(3-methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol (CHEBI:93562) is a dialkylarylamine (CHEBI:23665)
2-[[4-(3-methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol (CHEBI:93562) is a tertiary amino compound (CHEBI:50996)
Manual Xref Database
LSM-4002 LINCS
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